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canSAR1528399
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NAMES
    SMILES
    O=C(O)[C@H]1CC[C@@H](Nc2cc(-c3cccc(NCc4cccc(F)c4)n3)c(Cl)cn2)C1
    InChI
    InChI=1S/C23H22ClFN4O2/c24-19-13-27-22(28-17-8-7-15(10-17)23(30)31)11-18(19)20-5-2-6-21(29-20)26-12-14-3-1-4-16(25)9-14/h1-6,9,11,13,15,17H,7-8,10,12H2,(H,26,29)(H,27,28)(H,30,31)/t15-,17+/m0/s1
    MOLECULAR FORMULA
    C23H22ClFN4O2
    CROSS REFERENCES
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    canSAR1528399

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 440.14
    AlogP 5.21
    HBond donors 3
    HBond acceptors 6
    Atoms 53
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1528399.